기본 정보
- CAS
5031-74-3- 표준 SMILES
O=c1[nH]c2ccc(S(=O)(=O)CCO)cc2o1- InChIKey
NLKFSULXKPSHMS-UHFFFAOYSA-N- 분자식
- C9H9NO5S
- 평균 분자량
- 243.24 g/mol
- 단동위원소 질량
- 243.02014356
이름 및 식별자
- 우선 이름
- 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-
- IUPAC
- 6-(2-hydroxyethylsulfonyl)-3H-1,3-benzoxazol-2-one
- 현지명
- 6-[(2-히드록시에틸)술포닐]벤족사졸-2-(3H)-원
- 영어명
- 6-[(2-Hydroxyethyl)sulfonyl]benzoxazol-2-(3H)one
- 분자식
- C9H9NO5S
- 분자량
- 243.24
이름 및 동의어
2(3h)-benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-EINECS 225-722-5DTXSID70636832(3H)-Benzoxazolone, 6-((2-hydroxyethyl)sulfonyl)-6-[(2-Hydroxyethyl)sulfonyl]-2(3H)-benzoxazolone6-((2-Hydroxyethyl)sulphonyl)benzoxazol-2(3H)-one6-[(2-HYDROXYETHYL)SULPHONYL]BENZOXAZOL-2(3H)-ONE6-((2-Hydroxyethyl)sulfonyl)-2(3H)-benzoxazoloneRefChem:439854DTXCID2040818225-722-55031-74-3
이름 더 보기
6-[(2-히드록시에틸)술포닐]벤족사졸-2-(3H)-원6-[(2-히드록시에틸)술포닐]벤족사졸-2-(3H)온6-((2-HydroxyethyBenzoxazolone-6-Beta-Hydroxythylslfone6-[(2-Hydroxyethyl]benzoxazol-2-(3H)one6-[(2-hydroxyethyl)sulfonyl]-2(3h)-benzoxazolon6-(2-HYDROXY-ETHANESULFONYL)-3H-BENZOOXAZOL-2-ONE6-[(2-HYDROXYETHYL)-SULFONYL]-BENZOXAZOL-2(3H)-ONE6-[(2-Hydroxyethyl)sulfonyl]benzoxazol-2-(3H)one,98%
6-[(2-Hydroxyethyl)sulfonyl]benzoxazol-2-(3H)one6-(2-hydroxyethylsulfonyl)-3H-1,3-benzoxazol-2-one6-((2-Hydroxyethyl)sulfonyl)benzo[d]oxazol-2(3H)-one6-(2-hydroxyethanesulfonyl)-2,3-dihydro-1,3-benzoxazol-2-one6-[(2-Hydroxyethyl)sulfonyl]benzoxazol-2-(3H)-one6-[(2-hydroxyethyl)sulfonyl]-3-hydrobenzoxazol-2-one2(3H)-Benzoxazolone,6-[(2-hydroxyethyl)sulfonyl]-3FHG9Z4C25
데이터베이스 식별자
- CAS
5031-74-3- PubChem CID
- 78732
- DTXSID
DTXSID7063683- ChEMBL
CHEMBL4541663- UNII
- 3FHG9Z4C25
- EC Number
- 225-722-5
- Nikkaji
- J120.389D
물성
구조 계산 물성
- XLogP
- -0.3
- 극성 표면적
- 101 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 374
물리화학적 성질
- 녹는점
- 207 · 207-210 °C(lit.)
- EPA
- 2 · 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]- (5031-74-3)
화학적 성질
beige to grey powder
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36-37/39
화학 및 산업
용도 및 제조
General Manufacturing Information2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-: INACTIVE
공급사9 곳
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